CID 18971485

1-methyl-1h-pyrrole-2-sulfonamide

Structural Information

Molecular Formula
C5H8N2O2S
SMILES
CN1C=CC=C1S(=O)(=O)N
InChI
InChI=1S/C5H8N2O2S/c1-7-4-2-3-5(7)10(6,8)9/h2-4H,1H3,(H2,6,8,9)
InChIKey
CVGYKDZPLVGJAH-UHFFFAOYSA-N
Compound name
1-methylpyrrole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

160.03065 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.037926 130.2
[M+Na]+ 183.019868 140.5
[M-H]- 159.023374 133.2
[M+NH4]+ 178.064473 151.8
[M+K]+ 198.993808 138.4
[M+H-H2O]+ 143.027910 124.9
[M+HCOO]- 205.028851 149.8
[M+CH3COO]- 219.044501 173.7
[M+Na-2H]- 181.005316 134.0
[M]+ 160.03010142 131.7
[M]- 160.03119858 131.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe